methyl 3-[6-[5-(tert-butylcarbamoyl)-2-pyridin-3-yl-pyrazol-3-yl]pyridin-3-yl]propanoate

Systemtic Name: methyl 3-[6-[5-(tert-butylcarbamoyl)-2-pyridin-3-yl-pyrazol-3-yl]pyridin-3-yl]propanoate Openeye Name: methyl 3-[6-[5-(tert-butylcarbamoyl)-2-(3-pyridyl)pyrazol-3-yl]-3-pyridyl]propanoate CAS Name: 3-[6-[5-[(tert-butylamino)-oxomethyl]-2-(3-pyridinyl)-3-pyrazolyl]-3-pyridinyl]propanoic acid methyl ester IUPAC Name: methyl 3-[6-[5-(tert-butylcarbamoyl)-2-pyridin-3-ylpyrazol-3-yl]pyridin-3-yl]propanoate Traditional Name: 3-[6-[5-(tert-butylcarbamoyl)-2-(3-pyridyl)pyrazol-3-yl]-3-pyridyl]propionic acid methyl ester Formula: C22H25N5O3 MolecularWeight: 407.4656

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C1=NN(C(=C1)C2=NC=C(C=C2)CCC(=O)OC)C3=CN=CC=C3

Isomeric SMILES

CC(C)(C)NC(=O)C1=NN(C(=C1)C2=NC=C(C=C2)CCC(=O)OC)C3=CN=CC=C3

InChI

InChI=1S/C22H25N5O3/c1-22(2,3)25-21(29)18-12-19(27(26-18)16-6-5-11-23-14-16)17-9-7-15(13-24-17)8-10-20(28)30-4/h5-7,9,11-14H,8,10H2,1-4H3,(H,25,29)